%chk=000110880.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000110880

0 1
O 0.503089 0.766098 -2.615840
N -0.164777 0.283574 -0.490987
N 5.091599 -0.050182 0.850642
C -1.426481 -0.363240 -0.920276
C -1.412909 -1.895945 -0.626940
C -2.565144 -2.189705 0.361578
C -2.597059 0.171514 -0.120069
C -3.235758 -0.866030 0.598219
C -3.061781 1.476638 -0.049776
C -4.342634 -0.597431 1.393407
C 0.737259 0.808556 -1.419038
C 1.987990 1.437760 -0.833109
C 2.955141 0.371301 -0.311797
C -4.181472 1.748604 0.755252
C -4.811100 0.725536 1.466213
C 4.262077 1.011890 0.189225
C 6.093823 0.568040 1.770091
C 5.782568 -0.901909 -0.163019
H -1.569312 -0.175234 -2.019364
H -0.443276 -2.219999 -0.214758
H -1.544926 -2.458023 -1.566396
H -2.188327 -2.622375 1.305996
H -3.273388 -2.928389 -0.056397
H 0.019901 0.303932 0.506185
H -2.573012 2.273767 -0.606385
H -4.840252 -1.387839 1.947982
H 2.473754 2.035506 -1.636312
H 1.730870 2.163592 -0.037692
H 3.174036 -0.364089 -1.112660
H 2.494441 -0.212287 0.510885
H -4.559187 2.767021 0.820176
H -5.678290 0.950852 2.085245
H 4.786699 1.522378 -0.645720
H 4.024241 1.796907 0.939712
H 6.665450 -0.233250 2.266099
H 6.808029 1.251313 1.288654
H 5.562101 1.118157 2.562832
H 5.029245 -1.370373 -0.816959
H 6.507112 -0.372187 -0.798355
H 6.309260 -1.717851 0.357458


%chk=000110880-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000110880

0 1
O 0.940308 -0.254255 -1.744807
N -0.308863 -0.085382 0.211906
N 5.841525 0.156675 0.400309
C -1.529388 -0.676716 -0.352244
C -1.857994 -2.110179 0.185829
C -3.409954 -2.228165 0.102434
C -2.801540 0.106385 -0.031862
C -3.874776 -0.781515 0.232368
C -2.990203 1.501796 -0.001014
C -5.154303 -0.276393 0.537782
C 0.852611 0.093518 -0.526336
C 2.012755 0.762494 0.219448
C 3.358242 0.047704 -0.046666
C -4.275095 2.010628 0.311670
C -5.348837 1.126974 0.579986
C 4.549606 0.879398 0.468499
C 6.904794 0.868247 1.139078
C 6.260570 -0.163679 -0.980136
H -1.351354 -0.712830 -1.445222
H -1.536278 -2.173932 1.243375
H -1.326072 -2.893895 -0.378626
H -3.833414 -2.893196 0.876251
H -3.715057 -2.639506 -0.880811
H -0.322025 0.190281 1.196213
H -2.156901 2.181524 -0.214321
H -5.989769 -0.955273 0.745918
H 2.082502 1.805384 -0.153347
H 1.809695 0.821240 1.307134
H 3.431792 -0.127623 -1.134619
H 3.372826 -0.941403 0.448820
H -4.441068 3.093359 0.346188
H -6.337209 1.533052 0.823971
H 4.586910 1.849968 -0.099380
H 4.375203 1.139717 1.531990
H 7.827971 0.261171 1.139397
H 7.153791 1.871877 0.706321
H 6.594100 1.017509 2.188936
H 5.514204 -0.810645 -1.469691
H 6.402842 0.747216 -1.617847
H 7.217452 -0.714931 -0.952893


